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canSAR1587673
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NAMES
    SMILES
    COc1ccc(/C=C/C(=O)CC(=O)/C=C/c2ccc(N(C)C)c3ccccc23)cc1O
    InChI
    InChI=1S/C26H25NO4/c1-27(2)24-14-11-19(22-6-4-5-7-23(22)24)10-13-21(29)17-20(28)12-8-18-9-15-26(31-3)25(30)16-18/h4-16,30H,17H2,1-3H3/b12-8+,13-10+
    MOLECULAR FORMULA
    C26H25NO4
    CROSS REFERENCES
    1587673 logo

    canSAR1587673

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 415.18
    AlogP 4.87
    HBond donors 1
    HBond acceptors 5
    Atoms 56
    Contains toxicophore Yes
    Contains PAINS Yes
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1587673.